About N-phenazin-2-ylfuran-2-carboxamide
N-phenazin-2-ylfuran-2-carboxamide (PubChem CID 73349396) has the molecular formula C17H11N3O2
and a molecular weight of 289.29 g/mol. Its IUPAC name is N-phenazin-2-ylfuran-2-carboxamide.
Molecular Properties
| Compound Name | N-phenazin-2-ylfuran-2-carboxamide |
| PubChem CID | 73349396 |
| Molecular Formula | C17H11N3O2 |
| Molecular Weight | 289.29 g/mol |
| Exact Mass | 289.09 |
| IUPAC Name | N-phenazin-2-ylfuran-2-carboxamide |
| SMILES | O=C(Nc1ccc2nc3ccccc3nc2c1)c1ccco1 |
| InChI | InChI=1S/C17H11N3O2/c21-17(16-6-3-9-22-16)18-11-7-8-14-15(10-11)20-13-5-2-1-4-12(13)19-14/h1-10H,(H,18,21) |
| InChIKey | LYKGWVIVZWWMNP-UHFFFAOYSA-N |
| XLogP | 3.63 |
| TPSA | 68.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 289.29 |
| LogP ≤ 5 | 3.63 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-phenazin-2-ylfuran-2-carboxamide?
The IUPAC name of N-phenazin-2-ylfuran-2-carboxamide (CID 73349396) is N-phenazin-2-ylfuran-2-carboxamide.
What is the SMILES notation for N-phenazin-2-ylfuran-2-carboxamide?
The canonical SMILES for N-phenazin-2-ylfuran-2-carboxamide is O=C(Nc1ccc2nc3ccccc3nc2c1)c1ccco1.
What is the InChIKey of N-phenazin-2-ylfuran-2-carboxamide?
The InChIKey is LYKGWVIVZWWMNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N3O2/c21-17(16-6-3-9-22-16)18-11-7-8-14-15(10-11)20-13-5-2-1-4-12(13)19-14/h1-10H,(H,18,21).
What are the key properties of N-phenazin-2-ylfuran-2-carboxamide?
N-phenazin-2-ylfuran-2-carboxamide has a molecular weight of 289.29 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenazin-2-ylfuran-2-carboxamide is sourced from PubChem (CID 73349396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).